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PubMed code 20408530

Compile data set for download or QSAR
Found 98 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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 0.180n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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 0.600n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318269
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H22N6O2/c1-34-21-14-12-20(13-15-21)27-26(33)30-24-22-17-32(16-18-8-4-2-5-9-18)31-25(22)29-23(28-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H2,27,28,29,30,31,33)
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 2.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318272
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H20N6O/c32-25(26-20-14-8-3-9-15-20)29-23-21-17-31(16-18-10-4-1-5-11-18)30-24(21)28-22(27-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H2,26,27,28,29,30,32)
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 2.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318270
PNG
(CHEMBL1094143 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H19N5O/c31-25(20-14-8-3-9-15-20)28-23-21-17-30(16-18-10-4-1-5-11-18)29-24(21)27-22(26-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H,26,27,28,29,31)
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 3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50120759
PNG
(CHEMBL146479 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...)
Show SMILES Cc1cn2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2-12H,1H3,(H,20,21,22,23,25)
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 3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibition of human adenosine A3 receptor

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318271
PNG
(CHEMBL1094131 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H18ClN5O/c26-20-13-7-12-19(14-20)25(32)29-23-21-16-31(15-17-8-3-1-4-9-17)30-24(21)28-22(27-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,27,28,29,30,32)
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 3.70n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM21173
PNG
(1,3-dipropyl-8-cyclopentylxanthine | 8-cyclopentyl...)
Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1
Show InChI InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)
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 3.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318273
PNG
(3-chloro-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]py...)
Show SMILES Cn1cc2c(NC(=O)c3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H14ClN5O/c1-25-11-15-17(23-19(26)13-8-5-9-14(20)10-13)21-16(22-18(15)24-25)12-6-3-2-4-7-12/h2-11H,1H3,(H,21,22,23,24,26)
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 5.90n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM21220
PNG
((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...)
Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
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 6.20n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50293031
PNG
(2-chloro-N6-(3-iodobenzyl)-5'-N-methylcarbamoylade...)
Show SMILES CNC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|
Show InChI InChI=1S/C19H20ClIN6O5/c1-22-19(30)31-7-11-13(28)14(29)17(32-11)27-8-24-12-15(25-18(20)26-16(12)27)23-6-9-3-2-4-10(21)5-9/h2-5,8,11,13-14,17,28-29H,6-7H2,1H3,(H,22,30)(H,23,25,26)/t11-,13-,14-,17-/m1/s1
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 11n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM21220
PNG
((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...)
Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
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 14n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM21220
PNG
((2S,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-N-ethyl-3,...)
Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
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 20n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318275
PNG
(1-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Cn1cc2c(NC(=O)Nc3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H16N6O/c1-25-12-15-17(23-19(26)20-14-10-6-3-7-11-14)21-16(22-18(15)24-25)13-8-4-2-5-9-13/h2-12H,1H3,(H2,20,21,22,23,24,26)
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 20.9n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318278
PNG
(CHEMBL1099102 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H21N5O2/c1-33-21-14-12-20(13-15-21)26(32)29-24-22-17-31(16-18-8-4-2-5-9-18)30-25(22)28-23(27-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H,27,28,29,30,32)
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 22.1n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318276
PNG
(3-chloro-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H20ClN5O/c27-21-13-7-12-20(16-21)26(33)30-24-22-17-32(15-14-18-8-3-1-4-9-18)31-25(22)29-23(28-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H,28,29,30,31,33)
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 22.3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318280
PNG
(CHEMBL1098075 | N-(2-phenethyl-6-phenyl-2H-pyrazol...)
Show SMILES O=C(Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H21N5O/c32-26(21-14-8-3-9-15-21)29-24-22-18-31(17-16-19-10-4-1-5-11-19)30-25(22)28-23(27-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,27,28,29,30,32)
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 27n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318279
PNG
(1-(3-chlorophenyl)-3-(2-methyl-6-phenyl-2H-pyrazol...)
Show SMILES Cn1cc2c(NC(=O)Nc3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15ClN6O/c1-26-11-15-17(24-19(27)21-14-9-5-8-13(20)10-14)22-16(23-18(15)25-26)12-6-3-2-4-7-12/h2-11H,1H3,(H2,21,22,23,24,25,27)
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 29.1n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318277
PNG
(1-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidi...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H22N6O/c33-26(27-21-14-8-3-9-15-21)30-24-22-18-32(17-16-19-10-4-1-5-11-19)31-25(22)29-23(28-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H2,27,28,29,30,31,33)
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 36.3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318280
PNG
(CHEMBL1098075 | N-(2-phenethyl-6-phenyl-2H-pyrazol...)
Show SMILES O=C(Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H21N5O/c32-26(21-14-8-3-9-15-21)29-24-22-18-31(17-16-19-10-4-1-5-11-19)30-25(22)28-23(27-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,27,28,29,30,32)
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 43.7n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318281
PNG
(4-methoxy-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C27H23N5O2/c1-34-22-14-12-21(13-15-22)27(33)30-25-23-18-32(17-16-19-8-4-2-5-9-19)31-26(23)29-24(28-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H,28,29,30,31,33)
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 45.2n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318270
PNG
(CHEMBL1094143 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H19N5O/c31-25(20-14-8-3-9-15-20)28-23-21-17-30(16-18-10-4-1-5-11-18)29-24(21)27-22(26-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H,26,27,28,29,31)
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 53n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318274
PNG
(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C18H15N5/c19-16-15-12-23(11-13-7-3-1-4-8-13)22-18(15)21-17(20-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,19,20,21,22)
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 93n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318277
PNG
(1-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidi...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H22N6O/c33-26(27-21-14-8-3-9-15-21)30-24-22-18-32(17-16-19-10-4-1-5-11-19)31-25(22)29-23(28-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H2,27,28,29,30,31,33)
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 96n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50293031
PNG
(2-chloro-N6-(3-iodobenzyl)-5'-N-methylcarbamoylade...)
Show SMILES CNC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|
Show InChI InChI=1S/C19H20ClIN6O5/c1-22-19(30)31-7-11-13(28)14(29)17(32-11)27-8-24-12-15(25-18(20)26-16(12)27)23-6-9-3-2-4-10(21)5-9/h2-5,8,11,13-14,17,28-29H,6-7H2,1H3,(H,22,30)(H,23,25,26)/t11-,13-,14-,17-/m1/s1
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 120n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318282
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C25H19ClN6O/c26-19-12-7-13-20(14-19)27-25(33)30-23-21-16-32(15-17-8-3-1-4-9-17)31-24(21)29-22(28-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H2,27,28,29,30,31,33)
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 121n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318274
PNG
(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C18H15N5/c19-16-15-12-23(11-13-7-3-1-4-8-13)22-18(15)21-17(20-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,19,20,21,22)
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 121n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM21173
PNG
(1,3-dipropyl-8-cyclopentylxanthine | 8-cyclopentyl...)
Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1
Show InChI InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)
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 130n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318270
PNG
(CHEMBL1094143 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H19N5O/c31-25(20-14-8-3-9-15-20)28-23-21-17-30(16-18-10-4-1-5-11-18)29-24(21)27-22(26-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H,26,27,28,29,31)
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 181n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318280
PNG
(CHEMBL1098075 | N-(2-phenethyl-6-phenyl-2H-pyrazol...)
Show SMILES O=C(Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H21N5O/c32-26(21-14-8-3-9-15-21)29-24-22-18-31(17-16-19-10-4-1-5-11-19)30-25(22)28-23(27-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H,27,28,29,30,32)
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 227n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318272
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H20N6O/c32-25(26-20-14-8-3-9-15-20)29-23-21-17-31(16-18-10-4-1-5-11-18)30-24(21)28-22(27-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H2,26,27,28,29,30,32)
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 290n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318274
PNG
(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C18H15N5/c19-16-15-12-23(11-13-7-3-1-4-8-13)22-18(15)21-17(20-16)14-9-5-2-6-10-14/h1-10,12H,11H2,(H2,19,20,21,22)
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 312n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318276
PNG
(3-chloro-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H20ClN5O/c27-21-13-7-12-20(16-21)26(33)30-24-22-17-32(15-14-18-8-3-1-4-9-18)31-25(22)29-23(28-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H,28,29,30,31,33)
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 314n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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 334n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50120759
PNG
(CHEMBL146479 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...)
Show SMILES Cc1cn2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2-12H,1H3,(H,20,21,22,23,25)
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 350n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibition of human adenosine A1 receptor

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318285
PNG
(1-(4-methoxyphenyl)-3-(2-methyl-6-phenyl-2H-pyrazo...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(C)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C20H18N6O2/c1-26-12-16-18(24-20(27)21-14-8-10-15(28-2)11-9-14)22-17(23-19(16)25-26)13-6-4-3-5-7-13/h3-12H,1-2H3,(H2,21,22,23,24,25,27)
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 358n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318283
PNG
(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c20-17-16-13-24(12-11-14-7-3-1-4-8-14)23-19(16)22-18(21-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H2,20,21,22,23)
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 503n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318284
PNG
(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Cn1cc2c(N)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-17-7-9-10(13)14-11(15-12(9)16-17)8-5-3-2-4-6-8/h2-7H,1H3,(H2,13,14,15,16)
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 585n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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 728n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318273
PNG
(3-chloro-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]py...)
Show SMILES Cn1cc2c(NC(=O)c3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H14ClN5O/c1-25-11-15-17(23-19(26)13-8-5-9-14(20)10-13)21-16(22-18(15)24-25)12-6-3-2-4-7-12/h2-11H,1H3,(H,21,22,23,24,26)
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 886n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318284
PNG
(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Cn1cc2c(N)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-17-7-9-10(13)14-11(15-12(9)16-17)8-5-3-2-4-6-8/h2-7H,1H3,(H2,13,14,15,16)
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 922n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318283
PNG
(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c20-17-16-13-24(12-11-14-7-3-1-4-8-14)23-19(16)22-18(21-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H2,20,21,22,23)
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 1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318288
PNG
(1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-2H-pyr...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C27H24N6O2/c1-35-22-14-12-21(13-15-22)28-27(34)31-25-23-18-33(17-16-19-8-4-2-5-9-19)32-26(23)30-24(29-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H2,28,29,30,31,32,34)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318291
PNG
(CHEMBL1096692 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES COc1ccc(cc1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C20H17N5O2/c1-27-16-9-7-15(8-10-16)20(26)23-18-17-12-25(24-19(17)22-13-21-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H,21,22,23,24,26)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318290
PNG
(CHEMBL1094442 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES O=C(Nc1ncnc2nn(Cc3ccccc3)cc12)c1ccccc1
Show InChI InChI=1S/C19H15N5O/c25-19(15-9-5-2-6-10-15)22-17-16-12-24(23-18(16)21-13-20-17)11-14-7-3-1-4-8-14/h1-10,12-13H,11H2,(H,20,21,22,23,25)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318286
PNG
(CHEMBL1096693 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C19H14ClN5O/c20-15-8-4-7-14(9-15)19(26)23-17-16-11-25(24-18(16)22-12-21-17)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2,(H,21,22,23,24,26)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318289
PNG
(1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-2H-pyra...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C26H21ClN6O/c27-20-12-7-13-21(16-20)28-26(34)31-24-22-17-33(15-14-18-8-3-1-4-9-18)32-25(22)30-23(29-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H2,28,29,30,31,32,34)
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>1.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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 1.04E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318276
PNG
(3-chloro-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H20ClN5O/c27-21-13-7-12-20(16-21)26(33)30-24-22-17-32(15-14-18-8-3-1-4-9-18)31-25(22)29-23(28-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H,28,29,30,31,33)
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 1.05E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318273
PNG
(3-chloro-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]py...)
Show SMILES Cn1cc2c(NC(=O)c3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H14ClN5O/c1-25-11-15-17(23-19(26)13-8-5-9-14(20)10-13)21-16(22-18(15)24-25)12-6-3-2-4-7-12/h2-11H,1H3,(H,21,22,23,24,26)
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 1.08E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318281
PNG
(4-methoxy-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C27H23N5O2/c1-34-22-14-12-21(13-15-22)27(33)30-25-23-18-32(17-16-19-8-4-2-5-9-19)31-26(23)29-24(28-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H,28,29,30,31,33)
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 1.14E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318277
PNG
(1-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidi...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H22N6O/c33-26(27-21-14-8-3-9-15-21)30-24-22-18-32(17-16-19-10-4-1-5-11-19)31-25(22)29-23(28-24)20-12-6-2-7-13-20/h1-15,18H,16-17H2,(H2,27,28,29,30,31,33)
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 1.70E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50293031
PNG
(2-chloro-N6-(3-iodobenzyl)-5'-N-methylcarbamoylade...)
Show SMILES CNC(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3cccc(I)c3)nc(Cl)nc12 |r|
Show InChI InChI=1S/C19H20ClIN6O5/c1-22-19(30)31-7-11-13(28)14(29)17(32-11)27-8-24-12-15(25-18(20)26-16(12)27)23-6-9-3-2-4-10(21)5-9/h2-5,8,11,13-14,17,28-29H,6-7H2,1H3,(H,22,30)(H,23,25,26)/t11-,13-,14-,17-/m1/s1
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 2.10E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318281
PNG
(4-methoxy-N-(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C27H23N5O2/c1-34-22-14-12-21(13-15-22)27(33)30-25-23-18-32(17-16-19-8-4-2-5-9-19)31-26(23)29-24(28-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H,28,29,30,31,33)
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 2.40E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318283
PNG
(2-phenethyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Nc1nc(nc2nn(CCc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c20-17-16-13-24(12-11-14-7-3-1-4-8-14)23-19(16)22-18(21-17)15-9-5-2-6-10-15/h1-10,13H,11-12H2,(H2,20,21,22,23)
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 2.50E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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 3.18E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM21173
PNG
(1,3-dipropyl-8-cyclopentylxanthine | 8-cyclopentyl...)
Show SMILES CCCn1c2nc([nH]c2c(=O)n(CCC)c1=O)C1CCCC1
Show InChI InChI=1S/C16H24N4O2/c1-3-9-19-14-12(15(21)20(10-4-2)16(19)22)17-13(18-14)11-7-5-6-8-11/h11H,3-10H2,1-2H3,(H,17,18)
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 4.00E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318286
PNG
(CHEMBL1096693 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C19H14ClN5O/c20-15-8-4-7-14(9-15)19(26)23-17-16-11-25(24-18(16)22-12-21-17)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2,(H,21,22,23,24,26)
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 4.90E+3n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318279
PNG
(1-(3-chlorophenyl)-3-(2-methyl-6-phenyl-2H-pyrazol...)
Show SMILES Cn1cc2c(NC(=O)Nc3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15ClN6O/c1-26-11-15-17(24-19(27)21-14-9-5-8-13(20)10-14)22-16(23-18(15)25-26)12-6-3-2-4-7-12/h2-11H,1H3,(H2,21,22,23,24,25,27)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318288
PNG
(1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-2H-pyr...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C27H24N6O2/c1-35-22-14-12-21(13-15-22)28-27(34)31-25-23-18-33(17-16-19-8-4-2-5-9-19)32-26(23)30-24(29-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H2,28,29,30,31,32,34)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318278
PNG
(CHEMBL1099102 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H21N5O2/c1-33-21-14-12-20(13-15-21)26(32)29-24-22-17-31(16-18-8-4-2-5-9-18)30-25(22)28-23(27-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H,27,28,29,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318271
PNG
(CHEMBL1094131 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H18ClN5O/c26-20-13-7-12-19(14-20)25(32)29-23-21-16-31(15-17-8-3-1-4-9-17)30-24(21)28-22(27-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,27,28,29,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318269
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H22N6O2/c1-34-21-14-12-20(13-15-21)27-26(33)30-24-22-17-32(16-18-8-4-2-5-9-18)31-25(22)29-23(28-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H2,27,28,29,30,31,33)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318289
PNG
(1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-2H-pyra...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C26H21ClN6O/c27-20-12-7-13-21(16-20)28-26(34)31-24-22-17-33(15-14-18-8-3-1-4-9-18)32-25(22)30-23(29-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H2,28,29,30,31,32,34)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318289
PNG
(1-(3-chlorophenyl)-3-(2-phenethyl-6-phenyl-2H-pyra...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C26H21ClN6O/c27-20-12-7-13-21(16-20)28-26(34)31-24-22-17-33(15-14-18-8-3-1-4-9-18)32-25(22)30-23(29-24)19-10-5-2-6-11-19/h1-13,16-17H,14-15H2,(H2,28,29,30,31,32,34)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318284
PNG
(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Cn1cc2c(N)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C12H11N5/c1-17-7-9-10(13)14-11(15-12(9)16-17)8-5-3-2-4-6-8/h2-7H,1H3,(H2,13,14,15,16)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318285
PNG
(1-(4-methoxyphenyl)-3-(2-methyl-6-phenyl-2H-pyrazo...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(C)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C20H18N6O2/c1-26-12-16-18(24-20(27)21-14-8-10-15(28-2)11-9-14)22-17(23-19(16)25-26)13-6-4-3-5-7-13/h3-12H,1-2H3,(H2,21,22,23,24,25,27)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318288
PNG
(1-(4-methoxyphenyl)-3-(2-phenethyl-6-phenyl-2H-pyr...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(CCc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C27H24N6O2/c1-35-22-14-12-21(13-15-22)28-27(34)31-25-23-18-33(17-16-19-8-4-2-5-9-19)32-26(23)30-24(29-25)20-10-6-3-7-11-20/h2-15,18H,16-17H2,1H3,(H2,28,29,30,31,32,34)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318290
PNG
(CHEMBL1094442 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES O=C(Nc1ncnc2nn(Cc3ccccc3)cc12)c1ccccc1
Show InChI InChI=1S/C19H15N5O/c25-19(15-9-5-2-6-10-15)22-17-16-12-24(23-18(16)21-13-20-17)11-14-7-3-1-4-8-14/h1-10,12-13H,11H2,(H,20,21,22,23,25)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318291
PNG
(CHEMBL1096692 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES COc1ccc(cc1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C20H17N5O2/c1-27-16-9-7-15(8-10-16)20(26)23-18-17-12-25(24-19(17)22-13-21-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H,21,22,23,24,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318282
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C25H19ClN6O/c26-19-12-7-13-20(14-19)27-25(33)30-23-21-16-32(15-17-8-3-1-4-9-17)31-24(21)29-22(28-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H2,27,28,29,30,31,33)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318282
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Clc1cccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)c1
Show InChI InChI=1S/C25H19ClN6O/c26-19-12-7-13-20(14-19)27-25(33)30-23-21-16-32(15-17-8-3-1-4-9-17)31-24(21)29-22(28-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H2,27,28,29,30,31,33)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318279
PNG
(1-(3-chlorophenyl)-3-(2-methyl-6-phenyl-2H-pyrazol...)
Show SMILES Cn1cc2c(NC(=O)Nc3cccc(Cl)c3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15ClN6O/c1-26-11-15-17(24-19(27)21-14-9-5-8-13(20)10-14)22-16(23-18(15)25-26)12-6-3-2-4-7-12/h2-11H,1H3,(H2,21,22,23,24,25,27)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318285
PNG
(1-(4-methoxyphenyl)-3-(2-methyl-6-phenyl-2H-pyrazo...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(C)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C20H18N6O2/c1-26-12-16-18(24-20(27)21-14-8-10-15(28-2)11-9-14)22-17(23-19(16)25-26)13-6-4-3-5-7-13/h3-12H,1-2H3,(H2,21,22,23,24,25,27)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318278
PNG
(CHEMBL1099102 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C26H21N5O2/c1-33-21-14-12-20(13-15-21)26(32)29-24-22-17-31(16-18-8-4-2-5-9-18)30-25(22)28-23(27-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H,27,28,29,30,32)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318290
PNG
(CHEMBL1094442 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES O=C(Nc1ncnc2nn(Cc3ccccc3)cc12)c1ccccc1
Show InChI InChI=1S/C19H15N5O/c25-19(15-9-5-2-6-10-15)22-17-16-12-24(23-18(16)21-13-20-17)11-14-7-3-1-4-8-14/h1-10,12-13H,11H2,(H,20,21,22,23,25)
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Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318275
PNG
(1-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Cn1cc2c(NC(=O)Nc3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H16N6O/c1-25-12-15-17(23-19(26)20-14-10-6-3-7-11-14)21-16(22-18(15)24-25)13-8-4-2-5-9-13/h2-12H,1H3,(H2,20,21,22,23,24,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318269
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H22N6O2/c1-34-21-14-12-20(13-15-21)27-26(33)30-24-22-17-32(16-18-8-4-2-5-9-18)31-25(22)29-23(28-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H2,27,28,29,30,31,33)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318291
PNG
(CHEMBL1096692 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES COc1ccc(cc1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C20H17N5O2/c1-27-16-9-7-15(8-10-16)20(26)23-18-17-12-25(24-19(17)22-13-21-18)11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3,(H,21,22,23,24,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))		BDBM50318286
PNG
(CHEMBL1096693 | N-(2-benzyl-2H-pyrazolo[3,4-d]pyri...)
Show SMILES Clc1cccc(c1)C(=O)Nc1ncnc2nn(Cc3ccccc3)cc12
Show InChI InChI=1S/C19H14ClN5O/c20-15-8-4-7-14(9-15)19(26)23-17-16-11-25(24-18(16)22-12-21-17)10-13-5-2-1-3-6-13/h1-9,11-12H,10H2,(H,21,22,23,24,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318271
PNG
(CHEMBL1094131 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H18ClN5O/c26-20-13-7-12-19(14-20)25(32)29-23-21-16-31(15-17-8-3-1-4-9-17)30-24(21)28-22(27-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,27,28,29,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318272
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H20N6O/c32-25(26-20-14-8-3-9-15-20)29-23-21-17-31(16-18-10-4-1-5-11-18)30-24(21)28-22(27-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H2,26,27,28,29,30,32)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50120759
PNG
(CHEMBL146479 | N-(7-Methyl-2-phenyl-imidazo[1,2-a]...)
Show SMILES Cc1cn2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-13-12-24-18(20-13)21-16(14-8-4-2-5-9-14)22-19(24)23-17(25)15-10-6-3-7-11-15/h2-12H,1H3,(H,20,21,22,23,25)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibition of human adenosine A2A receptor

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))		BDBM50318275
PNG
(1-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES Cn1cc2c(NC(=O)Nc3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H16N6O/c1-25-12-15-17(23-19(26)20-14-10-6-3-7-11-14)21-16(22-18(15)24-25)13-8-4-2-5-9-13/h2-12H,1H3,(H2,20,21,22,23,24,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Displacement of [3H]NECA from human adenosine A2A receptor expressed in CHO cells

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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n/an/a 0.0610n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity at adenosine A3 receptor in human U87MG cells assessed as inhibition of Cl-IB-MECA-mediated ERK1/2 phosphorylation after 30 mins ...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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n/an/a 0.740n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity at adenosine A3 receptor in human U87MG cells assessed as inhibition of Cl-IB-MECA-mediated ERK1/2 phosphorylation after 30 mins ...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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n/an/a 1.90n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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n/an/a 2.40n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318272
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H20N6O/c32-25(26-20-14-8-3-9-15-20)29-23-21-17-31(16-18-10-4-1-5-11-18)30-24(21)28-22(27-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H2,26,27,28,29,30,32)
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n/an/a 5.70n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318271
PNG
(CHEMBL1094131 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H18ClN5O/c26-20-13-7-12-19(14-20)25(32)29-23-21-16-31(15-17-8-3-1-4-9-17)30-24(21)28-22(27-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,27,28,29,30,32)
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n/an/a 7.60n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318269
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H22N6O2/c1-34-21-14-12-20(13-15-21)27-26(33)30-24-22-17-32(16-18-8-4-2-5-9-18)31-25(22)29-23(28-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H2,27,28,29,30,31,33)
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n/an/a 8.20n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318268
PNG
(CHEMBL1096754 | N-(2-methyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Cn1cc2c(NC(=O)c3ccccc3)nc(nc2n1)-c1ccccc1
Show InChI InChI=1S/C19H15N5O/c1-24-12-15-17(22-19(25)14-10-6-3-7-11-14)20-16(21-18(15)23-24)13-8-4-2-5-9-13/h2-12H,1H3,(H,20,21,22,23,25)
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n/an/a 49.8n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A3


(Homo sapiens (Human))		BDBM50318270
PNG
(CHEMBL1094143 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H19N5O/c31-25(20-14-8-3-9-15-20)28-23-21-17-30(16-18-10-4-1-5-11-18)29-24(21)27-22(26-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H,26,27,28,29,31)
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n/an/a 53n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A3 receptor expressed in CHO cells assessed as blockade of NECA-mediated inhibition of forskolin-stim...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318267
PNG
(4-methoxy-N-(2-methyl-6-phenyl-2H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1)C(=O)Nc1nc(nc2nn(C)cc12)-c1ccccc1
Show InChI InChI=1S/C20H17N5O2/c1-25-12-16-18(23-20(26)14-8-10-15(27-2)11-9-14)21-17(22-19(16)24-25)13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22,23,24,26)
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n/an/a 53.9n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318270
PNG
(CHEMBL1094143 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES O=C(Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C25H19N5O/c31-25(20-14-8-3-9-15-20)28-23-21-17-30(16-18-10-4-1-5-11-18)29-24(21)27-22(26-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H,26,27,28,29,31)
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n/an/a 272n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318272
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES O=C(Nc1ccccc1)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H20N6O/c32-25(26-20-14-8-3-9-15-20)29-23-21-17-31(16-18-10-4-1-5-11-18)30-24(21)28-22(27-23)19-12-6-2-7-13-19/h1-15,17H,16H2,(H2,26,27,28,29,30,32)
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n/an/a 1.32E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318271
PNG
(CHEMBL1094131 | N-(2-benzyl-6-phenyl-2H-pyrazolo[3...)
Show SMILES Clc1cccc(c1)C(=O)Nc1nc(nc2nn(Cc3ccccc3)cc12)-c1ccccc1
Show InChI InChI=1S/C25H18ClN5O/c26-20-13-7-12-19(14-20)25(32)29-23-21-16-31(15-17-8-3-1-4-9-17)30-24(21)28-22(27-23)18-10-5-2-6-11-18/h1-14,16H,15H2,(H,27,28,29,30,32)
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n/an/a 1.33E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
Adenosine receptor A2b


(Homo sapiens (Human))		BDBM50318269
PNG
(1-(2-benzyl-6-phenyl-2H-pyrazolo[3,4-d]pyrimidin-4...)
Show SMILES COc1ccc(NC(=O)Nc2nc(nc3nn(Cc4ccccc4)cc23)-c2ccccc2)cc1
Show InChI InChI=1S/C26H22N6O2/c1-34-21-14-12-20(13-15-21)27-26(33)30-24-22-17-32(16-18-8-4-2-5-9-18)31-25(22)29-23(28-24)19-10-6-3-7-11-19/h2-15,17H,16H2,1H3,(H2,27,28,29,30,31,33)
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n/an/a 1.47E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Antagonist activity human recombinant adenosine A2B receptor expressed in CHO cells assessed as inhibition of NECA-mediated [3H]cAMP accumulation tre...

J Med Chem 53: 3954-63 (2010)


Article DOI: 10.1021/jm901785w
BindingDB Entry DOI: 10.7270/Q2N017HH
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%